- InChI
- InChI=1S/C25H50BrNO/c1-3-5-7-9-11-13-15-19-23-27(25(28)21-17-18-22-26)24-20-16-14-12-10-8-6-4-2/h3-24H2,1-2H3
- InChI Key
- ONNQWNPQXXXNQD-UHFFFAOYSA-N
- Formula
- C25H50BrNO
- SMILES
-
CCCCCCCCCCN(CCCCCCCCCC)C(=O)CC
CCBr - Molecular Weight1
- 460.57
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 155.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -578.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 70.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.47 | kJ/mol | Joback Calculated Property |
| log10WS | -9.06 | Crippen Calculated Property | |
| logPoct/wat | 8.662 | Crippen Calculated Property | |
| McVol | 392.160 | ml/mol | McGowan Calculated Property |
| Pc | 821.95 | kPa | Joback Calculated Property |
| Inp | [3127.00; 3127.00] |
|
|
| Inp | 3127.00 | NIST | |
| Inp | 3127.00 | NIST | |
| Tboil | 903.87 | K | Joback Calculated Property |
| Tc | 1107.79 | K | Joback Calculated Property |
| Tfus | 513.71 | K | Joback Calculated Property |
| Vc | 1.522 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1287.24; 1400.32] | J/mol×K | [903.87; 1107.79] |
|
| Cp,gas | 1287.24 | J/mol×K | 903.87 | Joback Calculated Property |
| Cp,gas | 1308.81 | J/mol×K | 937.86 | Joback Calculated Property |
| Cp,gas | 1329.19 | J/mol×K | 971.84 | Joback Calculated Property |
| Cp,gas | 1348.45 | J/mol×K | 1005.83 | Joback Calculated Property |
| Cp,gas | 1366.67 | J/mol×K | 1039.81 | Joback Calculated Property |
| Cp,gas | 1383.93 | J/mol×K | 1073.80 | Joback Calculated Property |
| Cp,gas | 1400.32 | J/mol×K | 1107.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentanamide, N,N-didecyl-5-bromo-.
Sources
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